6-chloranyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[2-(3-pyridyl)-2-pyrrolidin-1-yl-ethyl]-2H-chromene-3-carboxamide CAS Name: 6-chloro-N-[2-(3-pyridinyl)-2-(1-pyrrolidinyl)ethyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[2-(3-pyridyl)-2-pyrrolidino-ethyl]-2H-chromene-3-carboxamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2)C4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2)C4=CN=CC=C4

InChI

InChI=1S/C21H22ClN3O2/c22-18-5-6-20-16(11-18)10-17(14-27-20)21(26)24-13-19(25-8-1-2-9-25)15-4-3-7-23-12-15/h3-7,10-12,19H,1-2,8-9,13-14H2,(H,24,26)